mp_ID
stringlengths
4
10
x
float64
-10.28
17.7
y
float64
-12.01
23.9
z
float64
-8.99
7.96
type
stringclasses
2 values
formula
stringlengths
2
26
n_atoms
int64
1
444
spacegroup
int64
1
230
volume
float64
5.61
20.1k
mp-1516290
7.684308
10.824172
1.563575
other
Sr2Nb1Cu1O6
10
225
127.65
mp-1112323
-0.447919
1.088346
-4.617998
other
Cs2Y1Ag1Br6
10
225
370.91
mp-1111649
-0.328522
0.972599
-4.28313
original
K2Na1Sc1Br6
10
225
340.86
mp-1518723
9.379025
9.126925
2.080697
other
Ca2La1Sb1O6
10
225
157.28
mp-1519247
9.319414
9.133503
3.62646
other
Ba2Ce1Zr1O6
10
225
166.75
mp-1189828
7.457596
10.636704
-0.884179
other
Y1Cu6Cl1O8
16
225
200.61
mp-1111393
8.260002
0.612563
0.524189
other
Cs1Rb2Rh1F6
10
225
218.25
mp-1112659
-1.249368
2.914856
-2.932845
other
Cs2Na1Bi1I6
10
225
490.02
mp-1114035
1.229157
2.292019
-5.851167
other
K1Rb2Lu1Cl6
10
225
346.48
mp-1113551
-1.234866
2.924575
-2.966381
other
Rb2In1Hg1I6
10
225
450.62
mp-1110671
8.185707
1.156158
1.042091
other
K2Rb1Sb1F6
10
225
227.88
mp-1110969
8.146385
0.828316
1.820032
other
Cs2Li1Y1F6
10
225
179.93
mp-1111795
-1.216925
2.900931
-3.006069
other
Rb2Bi1Au1I6
10
225
447.34
mp-1110629
8.83874
0.824335
0.681369
other
Na2Li1Tl1F6
10
225
145.62
mp-1113688
8.446078
0.538615
0.603527
other
Rb2Na1Au1F6
10
225
175.97
mp-1207130
10.894805
8.730474
2.432746
other
Ba2Sm1U1O6
10
225
177.06
mp-1111386
8.582032
0.611956
1.515497
other
K2Rb1Al1F6
10
225
178.23
mp-1111737
-0.257216
1.069502
-4.280653
other
Na2Li1Y1Br6
10
225
325.93
mp-1518432
7.668511
8.671008
0.335125
other
Na1Eu1Hf2O6
10
225
138.03
mp-1110563
1.239767
2.364182
-5.989087
other
Cs2Na1Dy1Cl6
10
225
325.07
mp-1112056
-1.205673
2.559477
-2.566648
other
K2Y1Au1I6
10
225
439.63
mp-1112109
1.429238
2.71132
-5.941794
other
Cs2Tl1Bi1Cl6
10
225
388.42
mp-1110839
8.484565
1.524679
1.091078
other
K2Cu1Sb1F6
10
225
172.17
mp-1111834
-0.643705
0.964207
-4.203889
other
Cs2Li1Ta1Br6
10
225
328.3
mp-1228308
7.399585
10.850863
1.436497
other
Ba2Ta1Co1O6
10
225
130.47
mp-1214698
6.047694
8.5411
-0.83371
other
Ba2Ca1Bi1O6
10
225
168.84
mp-1205669
10.365936
10.557088
1.731879
other
Ba2Y1Mo1O6
10
225
154.21
mp-1113141
8.180617
0.586716
0.888539
other
Cs2Tl1Hg1F6
10
225
211.79
mp-1111104
8.808845
1.85688
1.612282
other
K2Na1Nb1F6
10
225
165.75
mp-996943
-0.46401
1.200565
-4.756209
other
Cs2Na1In1Br6
10
225
366.18
mp-1113070
-1.254034
2.910584
-2.946203
other
Cs2Cu1Bi1I6
10
225
428.86
mp-1111720
-0.539686
1.2302
-4.571612
other
Rb2Bi1Au1Br6
10
225
369.79
mp-1110936
-1.190459
2.419934
-2.347696
other
K2Li1Y1I6
10
225
428.48
mp-1114242
9.0482
0.988388
1.143944
other
Na2Li1Ga1F6
10
225
119.31
mp-1111597
-0.407299
1.002856
-4.37431
other
K2Rb1Sc1Br6
10
225
408.54
mp-1110836
8.378669
0.92245
1.719709
other
K2Li1Nd1F6
10
225
156.54
mp-1205643
10.780432
8.887806
2.775965
other
Ba2Ce1Pa1O6
10
225
184.86
mp-1113855
8.140745
0.904122
1.748896
other
Rb2Sc1Tl1F6
10
225
207.59
mp-1113934
8.325897
1.483399
1.251934
other
Rb2Ta1Hg1F6
10
225
245.93
mp-1521461
7.003767
10.589735
1.12116
other
Ba2Cr1Sn1O6
10
225
137.83
mp-1111217
8.745964
0.650687
1.14639
other
K2Rb1Cr1F6
10
225
189.51
mp-1112286
9.019971
0.498155
0.709447
other
K2Fe1Ag1F6
10
225
166.47
mp-1111973
1.381304
2.531041
-5.63342
other
K2Al1Ag1Cl6
10
225
261.04
mp-1205510
10.472202
11.040171
-0.122553
other
Re1Ni1Pb2O6
10
225
129.58
mp-1111402
8.128367
1.259909
0.934166
other
Rb2Sb1Au1F6
10
225
206.52
mp-1110914
-0.354692
1.015833
-4.251188
other
K2Pr1Ag1Br6
10
225
380.23
mp-1111193
-0.341387
0.957946
-4.327267
other
K2Sc1Tl1Br6
10
225
394.48
mp-1112625
1.557249
2.696827
-5.877211
other
Cs2K1As1Cl6
10
225
325.98
mp-1113974
1.178648
2.185742
-5.705364
other
Rb2Li1Tb1Cl6
10
225
289.61
mp-1111983
1.388606
2.596418
-5.755877
other
K2In1Au1Cl6
10
225
289.61
mp-1112627
-0.506256
1.21997
-4.715597
other
Cs2In1Ga1Br6
10
225
375.07
mp-14037
8.576689
1.051038
0.670515
other
Na1Tl2Rh1F6
10
225
163.06
mp-1205758
9.781264
10.902421
1.164332
other
Ba2Eu1Mo1O6
10
225
155.88
mp-1110917
-0.781864
1.262639
-4.363066
other
K2Ag1Mo1Br6
10
225
324.02
mp-1110670
8.09359
0.720579
1.555409
other
K2Rb1Y1F6
10
225
226.62
mp-1517218
9.174545
9.110614
2.492239
other
Sr2Tb1Sb1O6
10
225
149.02
mp-1111324
9.195472
0.509366
0.638876
other
Na2Mn1Ag1F6
10
225
155.99
mp-18848
9.718684
11.521969
0.955178
other
Sr2Mg1W1O6
10
225
129.41
mp-1113440
1.286485
2.478657
-6.019415
other
Cs2Tm1Ag1Cl6
10
225
315.12
mp-1521261
9.844144
9.760802
3.720364
other
Nd1Eu2Nb1O6
10
225
156.26
mp-1113094
-0.519547
1.202389
-4.684688
other
Cs2In1Sb1Br6
10
225
414.42
mp-1110706
-0.390026
1.123541
-4.368258
other
Rb2Li1Y1Br6
10
225
341.97
mp-1112513
8.141806
1.025721
1.132091
other
Cs2Rb1Sb1F6
10
225
239.25
mp-1209503
-0.344817
0.670626
-3.762922
other
Rb8Zr6Mn1Br20
35
225
1,247.79
mp-1112524
-0.521593
1.358226
-4.708504
other
Cs2Rb1Au1Br6
10
225
419.19
mp-1111018
8.545088
1.464869
0.864435
other
K1Na2As1F6
10
225
186.48
mp-989579
1.429871
2.524146
-5.749032
other
Rb2Li1Tl1Cl6
10
225
285.59
mp-1112416
1.169751
2.142611
-5.631522
other
Rb2Tb1Cu1Cl6
10
225
284.59
mp-1228067
9.326855
9.596589
3.083136
other
Ba2Zr1Sn1O6
10
225
150.11
mp-1112687
-1.265527
2.798397
-2.497485
other
Cs2K1Y1I6
10
225
526.89
mp-23763
8.712426
1.339459
-4.21848
other
Sn1H8N2Cl6
17
225
249.18
mp-1112129
1.367472
2.740156
-6.005029
other
Cs2Rb1Bi1Cl6
10
225
401.83
mp-1110987
8.087828
0.761646
1.547929
other
Cs2Y1Ag1F6
10
225
208.32
mp-1110657
8.787401
1.617844
1.066288
other
Na2Li1Sb1F6
10
225
148.48
mp-1084762
10.871195
11.049324
0.099788
other
Mn1Re1Pb2O6
10
225
135.89
mp-1110768
-1.258671
2.867687
-2.87916
other
Rb2Na1Sb1I6
10
225
469.8
mp-1112788
-0.549698
1.340796
-4.69961
other
Cs2K1Au1Br6
10
225
397.92
mp-1110747
-1.225306
2.519179
-2.391929
other
Rb2Li1Pr1I6
10
225
455.23
mp-1111414
8.572525
1.513649
1.405754
other
K2Ti1Tl1F6
10
225
197.87
mp-1112919
1.33803
2.558491
-6.038485
other
Cs2Y1Au1Cl6
10
225
321.46
mp-1111143
9.396751
2.189975
1.632885
other
Li2Cu1Mo1F6
10
225
147.85
mp-15317
8.126132
0.820376
1.835563
other
Rb2Na1Ho1F6
10
225
180.99
mp-1111531
1.297292
2.202668
-5.503335
other
Na2Lu1Ag1Cl6
10
225
291.27
mp-1205553
9.739788
9.767944
3.74662
other
Sr2Lu1Ta1O6
10
225
143.84
mp-989526
8.188488
0.630753
0.853213
other
Cs2K1Tl1F6
10
225
218.92
mp-1206536
9.297443
9.19716
1.276928
other
Ba2In1Sb1O6
10
225
147.91
mp-1111385
9.062716
0.236656
0.583506
other
K2Rb1Co1F6
10
225
179.51
mp-1113840
1.314463
2.102448
-5.455367
other
Na2Li1La1Cl6
10
225
293.94
mp-9319
7.123606
10.159286
0.831791
other
Ba2Pr1Pt1O6
10
225
161.24
mp-22442
7.349231
10.179897
0.679557
other
Ba2Na1Os1O6
10
225
148.04
mp-1523293
8.180539
6.968669
-1.550778
other
Ba2Sr1Se1O6
10
225
152.55
mp-1110778
-1.19781
2.548798
-2.403787
other
K2Rb1Nd1I6
10
225
568.33
mp-1112783
-1.239104
3.126232
-2.980254
other
Cs2K1Ga1I6
10
225
482.76
mp-989516
1.591978
2.830158
-5.310454
other
Cs2I1Cl6F1
10
225
303.83
mp-1519488
11.365903
10.403147
0.718141
other
Ca2V1Sb1O6
10
225
131.36
mp-1112427
1.453182
2.595157
-5.621749
other
K2Ga1Au1Cl6
10
225
267.61
mp-1112062
-1.258889
2.553235
-2.609215
other
K2Sc1Au1I6
10
225
412.07
mp-1111605
-0.539508
1.250545
-4.501317
other
K2Rb1Au1Br6
10
225
405.38
mp-568448
1.540531
2.735612
-5.855483
other
Cs2Ag1Au1Cl6
10
225
284.56
mp-1111674
-1.192782
2.363301
-2.302974
other
K2Li1Ce1I6
10
225
446.93